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Application

Discovery Studio 1.0 Materials Studio 0.8253837719298246 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.052845528455284556 Amorphous Cell 0.2609016999260902 Blends 0.0018477457501847746 CASTEP 0.2745750184774575 CDOCKER 0.19031781226903177 CHARMm 0.3056171470805617 COMPASS 0.3222468588322247 COMPASS III 0.10753880266075388 COSMObase 0.0040650406504065045 COSMOconf 0.005912786400591279 COSMOmic 0.0 COSMOperm 3.695491500369549E-4 COSMOplex 3.695491500369549E-4 COSMOquick 3.695491500369549E-4 COSMOtherm 0.058019216555801924 Catalyst 0.0827790096082779 Classical Simulations 1.0 Conformers 3.695491500369549E-4 Crystallization 0.07206208425720621 DFTB Plus 0.0033259423503325942 DMol3 0.12971175166297116 DPD 0.0018477457501847746 Discover 0.003695491500369549 Forcite 0.49889135254988914 GULP 0.013673318551367332 Kinetix 0.0 LUDI 0.003695491500369549 LibDock 0.07686622320768663 LigandFit 0.0040650406504065045 MODELER 0.2801182557280118 Mesocite 0.0033259423503325942 Mesoscale 0.004804138950480414 Morphology 0.015890613451589063 ONETEP 7.390983000739098E-4 Polymorph 0.0025868440502586844 QMERA 3.695491500369549E-4 Quantum Mechanics 0.3983739837398374 Reflex 0.052106430155210645 Reflex Plus 7.390983000739098E-4 Semi-empirical 0.004804138950480414 Sorption 0.059127864005912786 Synthia 7.390983000739098E-4 TURBOMOLE 0.0 VAMP 3.695491500369549E-4 Visualization 0.7483370288248337 X-Cell 0.0014781966001478197 ZDOCK 0.03067257945306726

Year

2024 0.12822719449225473 2025 1.0 2026 0.9153757888697648 2027 0.0

Keywords

target 1.0 potential 0.3408963060191262 docking 0.2615788486780424 analysis 0.24039002437652354 visualization 0.18563660228764298 between 0.13144571535720984 promising 0.09788111756984812 novel 0.09300581286330396 binding 0.09206825426589162 activity 0.05662853928370523 cell 0.05306581661353835 energy 0.0510031876992312 stability 0.03675229701856366 including 0.02943933995874742 strong 0.025126570410650667 performance 0.018001125070316894 development 0.012938308644290268 effective 0.011813238327395462 synthesized 0.009938121132570785 therapeutic 0.009563097693605851 mechanism 0.007687980498781174 protein 0.006750421901368836 enhanced 0.0035627226701668855 interaction 0.0018751171948246765 strategy 0.0
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